SCHEMBL2478461

SCHEMBL2478461

COc1cccc(-c2n[nH]c(S)c2-c2ccncc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.54
MAPK13 O15264 4/20 0.54
MAPK12 P53778 4/20 0.54
MAPK11 Q15759 4/20 0.54
RAF1 P04049 1/20 0.54
GAA P10253 1/20 0.49
ALOX5 P09917 1/20 0.47
BRAF P15056 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
DCUN1D1 Q96GG9 1/20 0.45
ROCK2 O75116 1/20 0.45
GRK2 P25098 1/20 0.45
GSK3A P49840 1/20 0.44
GSK3B P49841 1/20 0.44
DYRK1A Q13627 1/20 0.43
CLK4 Q9HAZ1 1/20 0.43
TEK Q02763 1/20 0.43
GCGR P47871 1/20 0.43
NTRK1 P04629 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2479781 0.81 MAPK14 (0.39) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL2479766 0.80 MAPK14 (0.44) MAPK14MAPK13MAPK12MAPK11NPC1
SCHEMBL1017069 0.79 MAPK14 (0.51) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL2479347 0.76 LRRK2 (0.46) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL5454847 0.75 CDC7 (0.49) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL8382254 0.75 NPC1 (0.62) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL2476444 0.74 ALOX5 (0.49) MAPK14ALOX5NPC1RAB9ACDC7
SCHEMBL1459110 0.72 MAPK14 (0.45) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL5453448 0.72 HSP90AA1 (0.50) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL1016030 0.71 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11RAF1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8524707-B2 Bicyclic pyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-09-03 US disclosed
EP-2373664-B1 BICYCLIC PYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2013-06-12 EP disclosed
US-20110257165-A1 BICYCLIC PYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-10-20 US disclosed
EP-2373664-A1 BICYCLIC PYRAZOLES AS PROTEIN KINASE INHIBITORS Nerviano Medical Sciences S.r.l. (IT) 2011-10-12 EP disclosed
WO-2010070060-A1 BICYCLIC PYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-06-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110257165-A1 BICYCLIC PYRAZOLES AS PROTEIN KINASE INHIBITORS MAP3K19, MAP4K3, MAP3K15 MAPK14 60/4885MAPK13 124/4885MAPK12 224/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.